4-azanyl-N-[4-[2-[(4-chlorophenyl)amino]-5-cyano-4-oxidanylidene-1H-pyrimidin-6-yl]phenyl]butanamide

Systemtic Name: 4-azanyl-N-[4-[2-[(4-chlorophenyl)amino]-5-cyano-4-oxidanylidene-1H-pyrimidin-6-yl]phenyl]butanamide Openeye Name: 4-amino-N-[4-[2-(4-chloroanilino)-5-cyano-4-oxo-1H-pyrimidin-6-yl]phenyl]butanamide CAS Name: 4-amino-N-[4-[2-(4-chloroanilino)-5-cyano-4-oxo-1H-pyrimidin-6-yl]phenyl]butanamide IUPAC Name: 4-amino-N-[4-[2-(4-chloroanilino)-5-cyano-4-oxo-1H-pyrimidin-6-yl]phenyl]butanamide Traditional Name: 4-amino-N-[4-[2-(4-chloroanilino)-5-cyano-4-keto-1H-pyrimidin-6-yl]phenyl]butyramide Formula: C21H19ClN6O2 MolecularWeight: 422.86756

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C2=C(C(=O)N=C(N2)NC3=CC=C(C=C3)Cl)C#N)NC(=O)CCCN

Isomeric SMILES

C1=CC(=CC=C1C2=C(C(=O)N=C(N2)NC3=CC=C(C=C3)Cl)C#N)NC(=O)CCCN

InChI

InChI=1S/C21H19ClN6O2/c22-14-5-9-16(10-6-14)26-21-27-19(17(12-24)20(30)28-21)13-3-7-15(8-4-13)25-18(29)2-1-11-23/h3-10H,1-2,11,23H2,(H,25,29)(H2,26,27,28,30)